Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH2 | P25021 | 2/20 | 0.57 |
| ▸ | HRH1 | P35367 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 11/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.48 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.48 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7732361 | 0.87 | HRH2 (0.58) | HRH2HRH1KDM4EHRH3KCNH2 | |
| SCHEMBL7738905 | 0.87 | HRH2 (0.55) | HRH2HRH1KDM4EHRH3 | |
| SCHEMBL7732374 | 0.87 | HRH2 (0.58) | HRH2HRH1KDM4EHRH3KCNH2 | |
| SCHEMBL7739073 | 0.87 | HRH2 (0.58) | HRH2HRH1KDM4EHRH3KCNH2 | |
| SCHEMBL7733935 | 0.85 | KDM4E (0.56) | HRH2HRH1KDM4EALDH1A1RAB9A | |
| SCHEMBL8362673 | 0.85 | HRH2 (0.58) | HRH2HRH1KDM4EALDH1A1RAB9A | |
| SCHEMBL7741813 | 0.83 | TMEM97 (0.68) | KDM4EALDH1A1 | |
| SCHEMBL7738909 | 0.82 | KDM4E (0.58) | HRH2HRH1KDM4EALDH1A1RAB9A | |
| SCHEMBL22066893 | 0.81 | HRH2 (0.65) | HRH2HRH1KDM4EALDH1A1HRH3 | |
| SCHEMBL7738349 | 0.81 | KDM4E (0.74) | KDM4EALDH1A1HRH3PSMB1PSMB5 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7790744-B2 | Cyclic peptide antifungal agents and process for preparation thereof | ELI LILLY AND COMPANY (US) | 2010-09-07 | — | — | US | disclosed |
| US-6743777-B1 | TRISPHENYL ACYL DERIVATIVES OF THE ECHINOCANDIN CLASS; CANDIDA ALBICANS; ANTIFUNGAL AND ANTIPARASITIC; CYCLIC HEXAPEPTIDES HAVING UNIQUE SIDE CHAIN ACYL GROUP | ELI LILLY AND COMPANY | 2004-06-01 | — | — | US | disclosed |